/disk2/worker/repository/td/SurfaceEnergyCubicCrystalBrokenBondFit__TD_955413365818_004/runner 
/disk2/worker/repository/td/SurfaceEnergyCubicCrystalBrokenBondFit__TD_955413365818_004/runner
Mo
bcc
Morse_Shifted_GirifalcoWeizer_1959MedCutoff_Mo__MO_534363225491_002
3.143500283360481e-10
1.072451086843125e-18